1-methyl-3-oxidanylidene-N-(2-pyridin-4-ylethyl)-2,1-benzothiazole-6-sulfonamide

Systemtic Name: 1-methyl-3-oxidanylidene-N-(2-pyridin-4-ylethyl)-2,1-benzothiazole-6-sulfonamide Openeye Name: 1-methyl-3-oxo-N-[2-(4-pyridyl)ethyl]-2,1-benzothiazole-6-sulfonamide CAS Name: 1-methyl-3-oxo-N-(2-pyridin-4-ylethyl)-2,1-benzothiazole-6-sulfonamide IUPAC Name: 1-methyl-3-oxo-N-(2-pyridin-4-ylethyl)-2,1-benzothiazole-6-sulfonamide Traditional Name: 3-keto-1-methyl-N-[2-(4-pyridyl)ethyl]-2,1-benzothiazole-6-sulfonamide Formula: C15H15N3O3S2 MolecularWeight: 349.4279

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=CC(=C2)S(=O)(=O)NCCC3=CC=NC=C3)C(=O)S1

Isomeric SMILES

CN1C2=C(C=CC(=C2)S(=O)(=O)NCCC3=CC=NC=C3)C(=O)S1

InChI

InChI=1S/C15H15N3O3S2/c1-18-14-10-12(2-3-13(14)15(19)22-18)23(20,21)17-9-6-11-4-7-16-8-5-11/h2-5,7-8,10,17H,6,9H2,1H3